Vitas-M small molecule compound
(2E)-2-[(1-acetyl-3-phenyl-1H-pyrazol-4-yl)methylidene]-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK758989
SMILES Cc1cc2nc3n(c2cc1C)c(=O)/c(=C\c1cn(nc1c1ccccc1)C(=O)C)/s3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H18N4O2S MW 414.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O2S/c1-13-9-18-19(10-14(13)2)27-22(29)20(30-23(27)24-18)11-17-12-26(15(3)28)25-21(17)16-7-5-4-6-8-16/h4-12H,1-3H3/b20-11+InChIKey
UPUJCSGQZQMCKY-RGVLZGJSSA-NSynonyms
(2E)2((1acetyl3phenyl1Hpyrazol4yl)methylidene)67dimethyl(13)thiazolo(32a)benzimidazol3(2H)one
(2E)2((1ACETYL3PHENYLPYRAZOL4YL)METHYLIDENE)67DIMETHYL(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
CC1=CC2=C(C=C1C)N3C(=O)C(=CC4=CN(N=C4C5=CC=CC=C5)C(=O)C)SC3=N2
Cc1cc2nc3n(c2cc1C)c(=O)c(=Cc1cn(nc1c1ccccc1)C(=O)C)s3
InChI=1SC23H18N4O2Sc11391819(1014(13)2)2722(29)20(3023(27)2418)11171226(15(3)28)2521(17)167546816h412H13H3b2011+
MFCD01446580
ZINC000004492263
ZINC04492263
ZINC4492263
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